Mol:LBF08102BC01
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 12 11 0 0 1 0 0 0 0 0999 V2000 | + | 12 11 0 0 1 0 0 0 0 0999 V2000 |
| − | -2.7996 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7996 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9350 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9350 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8506 0.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8506 0.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0442 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0442 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8237 0.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8237 0.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5203 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5203 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8237 -0.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8237 -0.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3443 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3443 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7996 0.3409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7996 0.3409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7996 -1.2364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7996 -1.2364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3081 0.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3081 0.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5216 1.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5216 1.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 11 1 0 0 0 0 | + | 1 11 1 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 5 4 1 0 0 0 0 | + | 5 4 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 5 7 1 4 0 0 0 | + | 5 7 1 4 0 0 0 |
| − | 6 8 1 0 0 0 0 | + | 6 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
| − | 2 11 2 0 0 0 0 | + | 2 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF08102BC01 | + | ID LBF08102BC01 |
| − | FORMULA C10H18O2 | + | FORMULA C10H18O2 |
| − | EXACTMASS 170.13067981999998 | + | EXACTMASS 170.13067981999998 |
| − | AVERAGEMASS 170.24872 | + | AVERAGEMASS 170.24872 |
| − | SMILES CC(C)=CCCC(C)CC(O)=O | + | SMILES CC(C)=CCCC(C)CC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
12 11 0 0 1 0 0 0 0 0999 V2000
-2.7996 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9350 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8506 0.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0442 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8237 0.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5203 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8237 -0.9945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3443 -0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7996 0.3409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7996 -1.2364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3081 0.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5216 1.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 11 1 0 0 0 0
3 2 1 0 0 0 0
3 4 1 0 0 0 0
5 4 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 4 0 0 0
6 8 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
2 11 2 0 0 0 0
11 12 1 0 0 0 0
S SKP 5
ID LBF08102BC01
FORMULA C10H18O2
EXACTMASS 170.13067981999998
AVERAGEMASS 170.24872
SMILES CC(C)=CCCC(C)CC(O)=O
M END
